Mrv1652309092222082D 22 23 0 0 1 0 999 V2000 3.3482 2.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8519 1.8587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6696 1.9683 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1733 1.3149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 1.4245 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3050 2.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1227 2.2970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8012 2.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4948 0.7711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1878 -0.0779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -0.8549 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2088 -0.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8977 -1.5573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8117 -1.3586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -0.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2315 -0.9739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7278 -0.3205 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2983 -1.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9162 -0.1721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8067 0.6456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5380 1.0957 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.0417 0.4424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 1 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 5 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 6 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 17 18 1 6 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 2 21 1 0 0 0 0 21 22 1 1 0 0 0 17 22 1 0 0 0 0 M END > NP0289780 > NP-MRD > CC(C)[C@@H]1CCC(=C)[C@@H]2CC[C@@](C)(O2)\C=C\C[C@@](C)(O)\C=C\1 > InChI=1S/C20H32O2/c1-15(2)17-8-7-16(3)18-10-14-20(5,22-18)12-6-11-19(4,21)13-9-17/h6,9,12-13,15,17-18,21H,3,7-8,10-11,14H2,1-2,4-5H3/b12-6+,13-9+/t17-,18+,19-,20+/m1/s1 > SOCRUWBAQPJTHY-WMIFLTCZSA-N > C20H32O2 > 304.474 > 304.24023027 > 2 > 54 > 36.22169074956343 > 1 > 1 > 0 > 1 > (1R,2E,5R,6E,8S,12S)-1,5-dimethyl-11-methylidene-8-(propan-2-yl)-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-5-ol > 4.488521847666666 > 0 > 2 > 0 > 18.410688235585894 > -1.3064618666701855 > 29.46 > 94.98429999999999 > 1 > 1 > (1R,2E,5R,6E,8S,12S)-8-isopropyl-1,5-dimethyl-11-methylidene-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-5-ol > 1 > NP0289780 > (1r,2e,5r,6e,8s,12s)-8-isopropyl-1,5-dimethyl-11-methylidene-15-oxabicyclo[10.2.1]pentadeca-2,6-dien-5-ol $$$$